| SpectraBase Compound ID | 7lkS3B1GW6D |
|---|---|
| InChI | InChI=1S/C7H11BrO/c8-6-4-2-1-3-5-7(6)9/h6H,1-5H2/i5D2,6D |
| InChIKey | JFNPFFAEYZRVJS-JQCZWRKMSA-N |
| Mol Weight | 194.09 g/mol |
| Molecular Formula | C7H8D3BrO |
| Exact Mass | 193.018158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AGQofx3cQW8 |
|---|---|
| Name | 2-Bromo-2,7,7-trideuterio-cycloheptanone |
| CAS Registry Number | 74975-89-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H8BrD3O |
| InChI | InChI=1S/C7H11BrO/c8-6-4-2-1-3-5-7(6)9/h6H,1-5H2/i5D2,6D |
| InChIKey | JFNPFFAEYZRVJS-JQCZWRKMSA-N |
| Literature Reference | P. Beak, K.R. Rogers, J. Am. Chem. Soc. 102, 3848 (1980). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |